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Name | CHEMBL3731933 |
---|---|
Molecular formula | C29H29FN6O5S |
IUPAC name | N-[7-(2-fluoro-5-methylanilino)-6-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonylpropanamide |
Molecular weight | 592.646 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 3.2 |
Synonyms | SCHEMBL15914783 FAMRNXWWAWQYPM-UHFFFAOYSA-N N-{7-(2-Fluoro-5-methylphenylamino)-6-[3H-spiro(isobenzofuran-1,4'-piperidine)-1'-carbonyl]pyrazolo[1,5-a]pyrimidin-3-ylsulfonyl}propionamide |
Inchi Key | FAMRNXWWAWQYPM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H29FN6O5S/c1-3-25(37)34-42(39,40)24-16-32-36-26(33-23-14-18(2)8-9-22(23)30)20(15-31-27(24)36)28(38)35-12-10-29(11-13-35)21-7-5-4-6-19(21)17-41-29/h4-9,14-16,33H,3,10-13,17H2,1-2H3,(H,34,37) |
PubChem CID | 90312380 |
ChEMBL | CHEMBL3731933 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
523700 | C-C chemokine receptor type 10 | P46092 | CCR10 | Homo sapiens (Human) | 362 |
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